[SIESTA-L] calculation of crystal orbital overlap population?

Dear list members, can anyone suggest a simple way for the calculation of the crystal orbital overlap population and construction of COOP plots? I suppose the starting point should be to set the WriteMullikenPop parameter to 3. Thank you in advance. Regards, Kyriakos.

[SIESTA-L] Tips for symmetry?

Hi all, Does anyone have any tips for getting better symmetry for geometry optimizations/relaxations (MD.typeofrun CG). Right now my relaxations are symmetric only to the second or third decimal place, but I would like much better symmetry (like to the 6th decimal place). I have tried making the